2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide

C7H9ClN2O4S — CID 165466217

IUPAC2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide
SMILESCNC(=O)c1cc(S(=O)(=O)NC)oc1Cl
InChIInChI=1S/C7H9ClN2O4S/c1-9-7(11)4-3-5(14-6(4)8)15(12,13)10-2/h3,10H,1-2H3,(H,9,11)
InChIKeyZTGBEGQITVHFJI-UHFFFAOYSA-N
MW252.68 g/mol
LogP0.20
Rot. Bonds3

About 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide

2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide (PubChem CID 165466217) has the molecular formula C7H9ClN2O4S and a molecular weight of 252.68 g/mol. Its IUPAC name is 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide
PubChem CID165466217
Molecular FormulaC7H9ClN2O4S
Molecular Weight252.68 g/mol
Exact Mass252.00
IUPAC Name2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide
SMILESCNC(=O)c1cc(S(=O)(=O)NC)oc1Cl
InChIInChI=1S/C7H9ClN2O4S/c1-9-7(11)4-3-5(14-6(4)8)15(12,13)10-2/h3,10H,1-2H3,(H,9,11)
InChIKeyZTGBEGQITVHFJI-UHFFFAOYSA-N
XLogP0.20
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.68
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide (CID 165466217) is 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide is CNC(=O)c1cc(S(=O)(=O)NC)oc1Cl.
What is the InChIKey of 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The InChIKey is ZTGBEGQITVHFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2O4S/c1-9-7(11)4-3-5(14-6(4)8)15(12,13)10-2/h3,10H,1-2H3,(H,9,11).
What are the key properties of 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide has a molecular weight of 252.68 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-methyl-5-(methylsulfamoyl)furan-3-carboxamide is sourced from PubChem (CID 165466217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).